TL;DR: BAS 01859810 (CAS 1285603-76-0) is a chemical compound with molecular formula C22H22N4O4 and molecular weight 406.1641 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[(E)-[[3-(4-propoxyphenyl)-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoate
Also Known As: BAS 01859810, (E)-methyl 4-((2-(3-(4-propoxyphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate, methyl 4-((1E)-2-{[3-(4-propoxyphenyl)pyrazol-5-yl]carbonylamino}-2-azavinyl)b enzoate, methyl 4-[(E)-({[3-(4-propoxyphenyl)-1H-pyrazol-5-yl]carbonyl}hydrazono)methyl]benzoate, methyl 4-[(E)-[[3-(4-propoxyphenyl)-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoate
| Molecular Formula | C22H22N4O4 |
| Molecular Weight | 406.1641 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 406.1641 Da |
| Heavy Atoms | 30 |
| Complexity | 584.0 |
| SMILES | CCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)C(=O)OC |
| InChIKey | ZXEMFDGKAPETSC-OEAKJJBVSA-N |
The XLogP value of 3.8 indicates that BAS 01859810 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01859810. Following Lipinski's Rule of Five, BAS 01859810 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 01859810 is 1285603-76-0.
The molecular formula of BAS 01859810 is C22H22N4O4.
The molecular weight of BAS 01859810 is 406.1641 g/mol.
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